2,3-bis(oxidanyl)propyl 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethanoate

Systemtic Name: 2,3-bis(oxidanyl)propyl 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethanoate Openeye Name: 2,3-dihydroxypropyl 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]acetate CAS Name: 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]acetic acid 2,3-dihydroxypropyl ester IUPAC Name: 2,3-dihydroxypropyl 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]acetate Traditional Name: 2-[6-amidino-2-(4-amidinophenyl)-1H-indol-3-yl]acetic acid glyceryl ester Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C3=C(N2)C=C(C=C3)C(=N)N)CC(=O)OCC(CO)O)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1C2=C(C3=C(N2)C=C(C=C3)C(=N)N)CC(=O)OCC(CO)O)C(=N)N

InChI

InChI=1S/C21H23N5O4/c22-20(23)12-3-1-11(2-4-12)19-16(8-18(29)30-10-14(28)9-27)15-6-5-13(21(24)25)7-17(15)26-19/h1-7,14,26-28H,8-10H2,(H3,22,23)(H3,24,25)